SCHEMBL27890168

SCHEMBL27890168

NCCCCC(Nc1cccc2ccccc12)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 5/20 0.61
▸ NTMT1 Q9BV86 2/20 0.57
▸ DPP4 P27487 1/20 0.42
▸ DPP8 Q6V1X1 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27906706 1.00 ACE (0.61) ACENTMT1DPP4DPP8
SCHEMBL11225012 0.85 ACE (0.68) ACE
SCHEMBL27890162 0.83 ACE (0.61) ACEDPP4DPP8
SCHEMBL27906704 0.83 ACE (0.61) ACEDPP4DPP8
SCHEMBL7326949 0.82 ACE (0.79) ACENTMT1
SCHEMBL27890164 0.80 ACE (0.73) ACEDPP4DPP8
SCHEMBL27890165 0.80 ACE (0.73) ACEDPP4DPP8
SCHEMBL10679400 0.79 ACE (0.66) ACE
SCHEMBL7326119 0.79 ACE (0.65) ACENTMT1
SCHEMBL17660482 0.77 ACE (0.75) ACE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102924567-A Peptide compound and preparation method and use of peptide compound SHANGHAI INST PHARM INDUSTRY 2013-02-13 — — CN claimed
CN-102924567-B Peptide compound and preparation method and use of peptide compound SHANGHAI INST PHARM INDUSTRY 2014-06-04 — — CN disclosed
CN-102924567-A Peptide compound and preparation method and use of peptide compound SHANGHAI INST PHARM INDUSTRY 2013-02-13 — — CN disclosed
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